SCHEMBL18857653

SCHEMBL18857653

C=NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCCCCN

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC15A2 Q16348 1/20 0.54
▸ SLC6A5 Q9Y345 1/20 0.53
▸ CPB2 Q96IY4 1/20 0.46
▸ EPHX2 P34913 1/20 0.45
▸ HRH3 Q9Y5N1 5/20 0.44
▸ HRH4 Q9H3N8 4/20 0.44
▸ HRH2 P25021 4/20 0.44
▸ ITGB2 P05107 1/20 0.43
▸ ICAM1 P05362 1/20 0.43
▸ ITGAL P20701 1/20 0.43
▸ FAAH O00519 1/20 0.43
▸ CNR1 P21554 1/20 0.43
▸ CNR2 P34972 1/20 0.43
▸ HRH1 P35367 5/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4653523 0.86 SLC6A5 (0.69) SLC15A2SLC6A5CPB2EPHX2HRH3
SCHEMBL18857761 0.86 SLC15A2 (0.58) SLC15A2SLC6A5CPB2EPHX2HRH3
SCHEMBL7887542 0.86 SLC6A5 (0.69) SLC15A2SLC6A5CPB2EPHX2HRH3
SCHEMBL7257727 0.85 SLC15A2 (0.69) SLC15A2SLC6A5CPB2EPHX2HRH3
SCHEMBL26126281 0.81 SLC15A2 (0.67) SLC15A2SLC6A5CPB2EPHX2HRH3
SCHEMBL21631681 0.81 SLC15A2 (0.67) SLC15A2SLC6A5CPB2EPHX2HRH3
SCHEMBL541262 0.81 SLC15A2 (0.67) SLC15A2SLC6A5CPB2EPHX2HRH3
Carnosine SCHEMBL22191128 0.80 SLC15A2 (0.69) SLC15A2SLC6A5CPB2EPHX2HRH3
SCHEMBL19051460 0.78 SLC15A2 (0.54) SLC15A2SLC6A5CPB2EPHX2ITGB2
SCHEMBL16819891 0.77 SLC15A2 (0.53) SLC15A2SLC6A5CPB2EPHX2HRH3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017083368-A9 TISSUE-SPECIFIC GENOME ENGINEERING USING CRISPR-CAS9 PFIZER INC. (US) 2018-04-12 — — WO disclosed
WO-2017083368-A1 TISSUE-SPECIFIC GENOME ENGINEERING USING CRISPR-CAS9 PFIZER INC. (US) 2017-05-18 — — WO disclosed
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